N-cyclopropyl-4-fluoranyl-3-[[2-[(2-nitrophenyl)amino]-1,3-thiazol-5-yl]methylamino]benzamide

Systemtic Name: N-cyclopropyl-4-fluoranyl-3-[[2-[(2-nitrophenyl)amino]-1,3-thiazol-5-yl]methylamino]benzamide Openeye Name: N-cyclopropyl-4-fluoro-3-[[2-(2-nitroanilino)thiazol-5-yl]methylamino]benzamide CAS Name: N-cyclopropyl-4-fluoro-3-[[2-(2-nitroanilino)-5-thiazolyl]methylamino]benzamide IUPAC Name: N-cyclopropyl-4-fluoro-3-[[2-(2-nitroanilino)-1,3-thiazol-5-yl]methylamino]benzamide Traditional Name: N-cyclopropyl-4-fluoro-3-[[2-(2-nitroanilino)thiazol-5-yl]methylamino]benzamide Formula: C20H18FN5O3S MolecularWeight: 427.452023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=C(C=C2)F)NCC3=CN=C(S3)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=C(C=C2)F)NCC3=CN=C(S3)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H18FN5O3S/c21-15-8-5-12(19(27)24-13-6-7-13)9-17(15)22-10-14-11-23-20(30-14)25-16-3-1-2-4-18(16)26(28)29/h1-5,8-9,11,13,22H,6-7,10H2,(H,23,25)(H,24,27)